Basic information
- Standard SMILES
CC(C)(CNc1nnc(Cl)cc1C(N)=O)c1ccc(F)cc1- InChIKey
BUCJQXKYLZEFRS-UHFFFAOYSA-N- Molecular formula
- C15H16ClFN4O
- Average molar mass
- 322.76 g/mol
- Monoisotopic mass
- 322.099667
Names & identifiers
- Preferred name
- 6-Chloro-3-(2-(4-fluorophenyl)-2-methylpropylamino)pyridazine-4-carboxamide
- IUPAC
- 6-chloro-3-[[2-(4-fluorophenyl)-2-methylpropyl]amino]pyridazine-4-carboxamide
Names & synonyms
SCHEMBL2558301BUCJQXKYLZEFRS-UHFFFAOYSA-N6-Chloro-3-(2-(4-fluorophenyl)-2-methylpropylamino)pyridazine-4-carboxamide
Database identifiers
- PubChem CID
- 86686133
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 388
Related reactions
2 records
Compound notes
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